Geometry & MOs

Info

ID:	409470
PubChem CID:	135082252
Reduced:	FCl2N2O2C16H23 (1)
Stoich.:	AB2C2D2E16F23 (1)
Weight, g/mol:	503.985727
ΔH_f, kcal/mol:	-153.02
Dipole, Da:	5.41
IP(EA), eV:	-9.53(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-5-amino-3-[(2,4-difluoro-5-nitrophenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid

Drug info:

PubChemData

Smile

CCCCCCC(C)CC(=O)COC1=NC(=C(C(=C1Cl)N)Cl)F

DOS

IR

Vibrations